SCHEMBL6421432

SCHEMBL6421432

CCCC(C)CC(CC(=O)O)NC(=O)C[AsH2]

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PLA2G10 O15496 4/20 0.43
PLA2G2C Q5R387 1/20 0.35
POLB P06746 2/20 0.32
CACNA2D1 P54289 2/20 0.32
CACNB3 P54284 1/20 0.32
CACNA1C Q13936 1/20 0.32
PGR P06401 1/20 0.32
ADRA1A P35348 1/20 0.32
HTR2B P41595 1/20 0.32
CACNA2D2 Q9NY47 1/20 0.32
GPR84 Q9NQS5 4/20 0.31
TSHR P16473 1/20 0.31
LMNA P02545 1/20 0.30
MME P08473 1/20 0.30
ITGB3 P05106 2/20 0.30
ITGA2B P08514 2/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5698146 0.87 PLA2G10 (0.42) PLA2G10PLA2G2CPOLBCACNA2D1CACNB3
SCHEMBL4015335 0.84 PLA2G10 (0.43) PLA2G10PLA2G2CPOLBCACNA2D1CACNB3
SCHEMBL4005328 0.84 PLA2G10 (0.43) PLA2G10PLA2G2CPOLBCACNA2D1CACNB3
SCHEMBL4008884 0.84 PLA2G10 (0.43) PLA2G10PLA2G2CPOLBCACNA2D1CACNB3
SCHEMBL4009802 0.83 PLA2G10 (0.42) PLA2G10PLA2G2CPOLBCACNA2D1CACNB3
SCHEMBL4211648 0.82 PLA2G10 (0.40) PLA2G10PLA2G2CCACNA2D1CACNB3CACNA1C
SCHEMBL4014313 0.81 PLA2G10 (0.40) PLA2G10PLA2G2CPOLBCACNA2D1CACNB3
SCHEMBL4009547 0.80 PLA2G10 (0.41) PLA2G10PLA2G2CPOLBCACNA2D1CACNB3
SCHEMBL4014168 0.78 DPP8 (0.42) PLA2G10CACNA2D1CACNB3CACNA1CPGR
SCHEMBL4010164 0.78 DPP8 (0.42) PLA2G10CACNA2D1CACNB3CACNA1CPGR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050070483-A1 Prodrugs of amino acids with affinity for the alpha2delta-protein VIATRIS SPECIALTY LLC. 2005-03-31 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050070483-A1 Prodrugs of amino acids with affinity for the alpha2delta-protein SCN2A, OPRD1, SCN1A PLA2G10 2762/4885PLA2G2C 1607/4885POLB 3619/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.